Bavachalcone
TL;DR: Bavachalcone (CAS 20784-60-5) is a chemical compound with molecular formula C21H22O4 and molecular weight 338.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-1-[2-hydroxy-4-methoxy-5-(3-methylbut-2-enyl)phenyl]-3-(4-hydroxyphenyl)prop-2-en-1-one
Also Known As: Bavachalcone, 4'-O-Methylbroussochalcone B, 4'-O-Methylbavachalcone, 4-O-methylbavachalcone, O-Methylbroussochalcone B
| Molecular Formula | C21H22O4 |
|---|---|
| Molecular Weight | 338.15 g/mol |
| LogP | 4.5112 |
| Topological Polar Surface Area | 66.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 338.1518 |
| Heavy Atoms | 25 |
| Complexity | 810.53485 |
Chemical Identifiers
| CAS Number | 20784-60-5 |
|---|---|
| SMILES | CC(=CCC1=CC(=C(C=C1OC)O)C(=O)/C=C/C2=CC=C(C=C2)O)C |
Product Overview
Bavachalcone (CAS 20784-60-5), with molecular formula C21H22O4 and molecular weight 338.15 g/mol. IUPAC: (E)-1-[2-hydroxy-4-methoxy-5-(3-methylbut-2-enyl)phenyl]-3-(4-hydroxyphenyl)prop-2-en-1-one.
Chemical Property Profile of Bavachalcone
Property Insights of Bavachalcone
The XLogP value of 4.5112 indicates that Bavachalcone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.76 Ų falls within the moderate polarity range, balancing permeability and solubility for Bavachalcone. Following Lipinski's Rule of Five, Bavachalcone has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bavachalcone?
The CAS number of Bavachalcone is 20784-60-5.
What is the molecular formula of Bavachalcone?
The molecular formula of Bavachalcone is C21H22O4.
What is the molecular weight of Bavachalcone?
The molecular weight of Bavachalcone is 338.15 g/mol.
Where can I buy Bavachalcone?
You can request a quote for Bavachalcone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bavachalcone?
Yes, KEHONG BIO provides custom synthesis services for Bavachalcone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.